(3E)-7-tert-butyl-5-methyl-3-propylidene-2H-1,3-benzoxazol-3-ium

Systemtic Name: (3E)-7-tert-butyl-5-methyl-3-propylidene-2H-1,3-benzoxazol-3-ium Openeye Name: (3E)-7-tert-butyl-5-methyl-3-propylidene-2H-1,3-benzoxazol-3-ium CAS Name: (3E)-7-tert-butyl-5-methyl-3-propylidene-2H-1,3-benzoxazol-3-ium IUPAC Name: (3E)-7-tert-butyl-5-methyl-3-propylidene-2H-1,3-benzoxazol-3-ium Traditional Name: (3E)-7-tert-butyl-5-methyl-3-propylidene-2H-1,3-benzoxazol-3-ium Formula: C15H22NO+ MolecularWeight: 232.34128

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Descriptors Computed from Structure

Canonical SMILES:

CCC=[N+]1COC2=C(C=C(C=C21)C)C(C)(C)C

Isomeric SMILES

CC/C=[N+]\1/COC2=C(C=C(C=C21)C)C(C)(C)C

InChI

InChI=1S/C15H22NO/c1-6-7-16-10-17-14-12(15(3,4)5)8-11(2)9-13(14)16/h7-9H,6,10H2,1-5H3/q+1/b16-7-